Messages by Date
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2021/05/29
[Avogadro-Discuss] Atom selection and Energy minimization in Avogadro 1.93.0 (Avogadro 2)
Abhijit Gogoi
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2021/03/12
Re: [Avogadro-Discuss] [Openchemistry-users] Avogardo 2 - vasp.xml
Geoffrey Hutchison
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2020/12/01
[Avogadro-Discuss] surface map plot
Takashi Inoue
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2020/04/22
[Avogadro-Discuss] obminimize stop criteria
Marco Di Gennaro (TME)
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2020/03/25
Re: [Avogadro-Discuss] Help , email list requests for GSoC
Geoffrey Hutchison
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2020/03/25
[Avogadro-Discuss] Help , email list requests for GSoC
Arjeta Selmani
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2020/02/07
[Avogadro-Discuss] Charge density of a molecule
Gurpreet Kathuria
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2020/01/23
[Avogadro-Discuss] Visualizing vibrations from NWChem
Christos Deligkaris
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2019/06/19
[Avogadro-Discuss] Right-Handed Z-DNA?
Eric R Beyerle
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2019/06/15
[Avogadro-Discuss] avogadro compilation problem
sunyeping via Avogadro-Discuss
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2019/05/04
[Avogadro-Discuss] 2019 Avogadro UGM - Planning?
Geoffrey Hutchison
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2019/01/30
Re: [Avogadro-Discuss] Symbol Lookup Error
Geoffrey Hutchison
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2019/01/30
Re: [Avogadro-Discuss] Symbol Lookup Error
Geoffrey Hutchison
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2019/01/30
[Avogadro-Discuss] Symbol Lookup Error
Freja Eilsø Storm
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2018/10/22
[Avogadro-Discuss] Avogadro with Python api install on linux
Bennion, Brian via Avogadro-Discuss
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2018/06/26
[Avogadro-Discuss] Community Survey
Geoffrey Hutchison
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2018/05/01
[Avogadro-Discuss] Avogadro2
Takashi Inoue
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2018/04/01
[Avogadro-Discuss] August 25 Workshop - University of Pittsburgh
Geoffrey Hutchison
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2018/02/08
[Avogadro-Discuss] Migrating to Discuss.Avogadro.cc
Geoffrey Hutchison
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2018/01/31
Re: [Avogadro-Discuss] Installation error using last git versions of avogadro and openbabel
Geoffrey Hutchison
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2018/01/31
[Avogadro-Discuss] Installation error using last git versions of avogadro and openbabel
Javier Cerezo
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2017/12/13
Re: [Avogadro-Discuss] supercell
Geoffrey Hutchison
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2017/12/12
Re: [Avogadro-Discuss] Translation
William Gambazza via Avogadro-Discuss
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2017/12/12
Re: [Avogadro-Discuss] Translation
Geoffrey Hutchison
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2017/12/08
[Avogadro-Discuss] supercell
Sugan Ya
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2017/12/07
[Avogadro-Discuss] Translation
William Gambazza via Avogadro-Discuss
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2017/07/21
Re: [Avogadro-Discuss] Avogdro v-1.2.0 Won't Open in v-9.0.0
Geoffrey Hutchison
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2017/07/20
[Avogadro-Discuss] Fwd: Avogdro v-1.2.0 Won't Open in v-9.0.0
Stephen P. Molnar
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2017/07/20
[Avogadro-Discuss] Avogdro v-1.2.0 Won't Open in v-9.0.0
Stephen P. Molnar
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2017/07/06
Re: [Avogadro-Discuss] Avogadro software
Geoffrey Hutchison
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2017/05/24
[Avogadro-Discuss] question about germanene nanoribbon
Azadeh Ayatollahie
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2017/05/23
[Avogadro-Discuss] (no subject)
Azadeh Ayatollahie
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2017/05/23
[Avogadro-Discuss] question about germanene nanoribbon
Azadeh Ayatollahie
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2017/05/14
[Avogadro-Discuss] question about germanene nanoribbon
Azadeh Ayatollahie
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2017/05/02
Re: [Avogadro-Discuss] Avogradro installation problem (Linux)
Hülsmann , Marco
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2017/05/01
Re: [Avogadro-Discuss] Avogradro installation problem (Linux)
Geoffrey Hutchison
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2017/04/28
[Avogadro-Discuss] Avogradro installation problem (Linux)
Hülsmann , Marco
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2017/04/24
Re: [Avogadro-Discuss] UNL after using Fill Unit Cell
Željko M . Svedružić
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2017/04/24
Re: [Avogadro-Discuss] UNL after using Fill Unit Cell
Geoffrey Hutchison
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2017/04/23
[Avogadro-Discuss] UNL after using Fill Unit Cell
Nash, Anthony
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2017/03/28
Re: [Avogadro-Discuss] GSoC person to contact in regard to Molecular Dynamics project in Avogadro2
Marcus D. Hanwell
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2017/03/27
[Avogadro-Discuss] GSoC person to contact in regard to Molecular Dynamics project in Avogadro2
Piyush Divyankar
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2017/03/24
[Avogadro-Discuss] Want to Support Avogadro?
Geoffrey Hutchison
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2017/02/14
[Avogadro-Discuss] question about the expected behaviour of "Label"
Davide Olianas
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2017/02/10
[Avogadro-Discuss] New Website
Geoffrey Hutchison
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2017/01/31
Re: [Avogadro-Discuss] Avogadro Crash while reading an output file.
Geoffrey Hutchison
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2017/01/30
Re: [Avogadro-Discuss] Avogadro Crash while reading an output file.
Željko M . Svedružić
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2017/01/30
Re: [Avogadro-Discuss] Avogadro Crash while reading an output file.
tim hockswender
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2017/01/28
Re: [Avogadro-Discuss] Avogadro Crash while reading an output file.
Željko M . Svedružić
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2017/01/28
Re: [Avogadro-Discuss] Avogadro Crash while reading an output file.
Geoffrey Hutchison
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2017/01/24
[Avogadro-Discuss] freeze upon start - but for one user only
Stanislav Šimko
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2017/01/13
Re: [Avogadro-Discuss] Issue with Eigen3/avogadro1.1
Geoffrey Hutchison
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2017/01/13
[Avogadro-Discuss] Issue with Eigen3/avogadro1.1
Javier Cerezo
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2016/12/28
Re: [Avogadro-Discuss] [Avogadro-devel] Workflow Scripts (for Avo2)
Geoffrey Hutchison
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2016/12/28
Re: [Avogadro-Discuss] [Avogadro-devel] Workflow Scripts (for Avo2)
Marcus D. Hanwell
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2016/12/28
Re: [Avogadro-Discuss] [Avogadro-devel] Workflow Scripts (for Avo2)
Gary Kedziora
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2016/12/28
Re: [Avogadro-Discuss] some help for two avogadro extensions and a question on beta orbitals
Geoffrey Hutchison
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2016/12/21
Re: [Avogadro-Discuss] some help for two avogadro extensions and a question on beta orbitals
Davide Olianas
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2016/12/21
Re: [Avogadro-Discuss] some help for two avogadro extensions and a question on beta orbitals
Geoffrey Hutchison
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2016/12/21
[Avogadro-Discuss] some help for two avogadro extensions and a question on beta orbitals
Davide Olianas
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2016/12/05
[Avogadro-Discuss] python terminal: obtain current selection of atoms [avogadro 1]
Davide Olianas
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2016/11/19
Re: [Avogadro-Discuss] chirality
Željko M . Svedružić
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2016/11/19
Re: [Avogadro-Discuss] chirality
Geoffrey Hutchison
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2016/11/19
[Avogadro-Discuss] chirality
Andre Persoons
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2016/11/17
Re: [Avogadro-Discuss] viewing orbitals from mopac output
Geoffrey Hutchison
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2016/11/17
Re: [Avogadro-Discuss] viewing orbitals from mopac output
Steven Wathen
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2016/11/17
Re: [Avogadro-Discuss] viewing orbitals from mopac output
Geoffrey Hutchison
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2016/11/17
[Avogadro-Discuss] viewing orbitals from mopac output
Steven Wathen
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2016/11/16
Re: [Avogadro-Discuss] Problem Compiling Avogadro v-1.2.0
Geoffrey Hutchison
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2016/11/16
Re: [Avogadro-Discuss] Problem Compiling Avogadro v-1.2.0
S. P. Molnar
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2016/11/16
Re: [Avogadro-Discuss] Problem Compiling Avogadro v-1.2.0
Patrick Avery
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2016/11/11
Re: [Avogadro-Discuss] two problems with Avogadro1.1 and 1.2
Geoffrey Hutchison
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2016/11/10
Re: [Avogadro-Discuss] paid modeling work and/or tutor
Geoffrey Hutchison
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2016/11/10
Re: [Avogadro-Discuss] paid modeling work and/or tutor
Marcus D. Hanwell
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2016/11/10
Re: [Avogadro-Discuss] paid modeling work and/or tutor
Tim Potter
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2016/11/09
Re: [Avogadro-Discuss] paid modeling work and/or tutor
Marcus D. Hanwell
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2016/11/09
Re: [Avogadro-Discuss] can not get coordinates of rotated molecule
Geoffrey Hutchison
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2016/11/09
[Avogadro-Discuss] can not get coordinates of rotated molecule
Ilias Miroslav, doc. RNDr., PhD.
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2016/11/08
[Avogadro-Discuss] paid modeling work and/or tutor
Tim Potter
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2016/11/02
[Avogadro-Discuss] What Service to Use for Community Support
Geoffrey Hutchison
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2016/10/24
Re: [Avogadro-Discuss] AutoOptimization
Marcus D. Hanwell
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2016/10/23
Re: [Avogadro-Discuss] AutoOptimization
Patrick Avery
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2016/10/23
Re: [Avogadro-Discuss] AutoOptimization
Marcos Verissimo Alves
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2016/10/23
Re: [Avogadro-Discuss] AutoOptimization
Patrick Avery
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2016/10/23
Re: [Avogadro-Discuss] AutoOptimization
Željko M . Svedružić
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2016/10/23
Re: [Avogadro-Discuss] AutoOptimization
Andre Persoons
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2016/10/22
Re: [Avogadro-Discuss] AutoOptimization
Michael Morgan
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2016/10/22
Re: [Avogadro-Discuss] AutoOptimization
Patrick Avery
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2016/09/12
Re: [Avogadro-Discuss] [Avogadro-devel] GSoC 2016
David Lonie
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2016/09/11
[Avogadro-Discuss] GSoC 2016
Patrick Avery
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2016/09/09
[Avogadro-Discuss] Increasing Financial Support for Avogadro
Geoffrey Hutchison
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2016/09/06
Re: [Avogadro-Discuss] Yaehmop Additions
David Lonie
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2016/09/04
[Avogadro-Discuss] Yaehmop Additions
Patrick Avery
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2016/08/29
Re: [Avogadro-Discuss] Algorithm of conformer search
sho
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2016/08/28
[Avogadro-Discuss] Algorithm of conformer search
yamashita.ryoto....@st.kyoto-u.ac.jp
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2016/07/28
Re: [Avogadro-Discuss] SMILES strings
Marcos Verissimo Alves
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2016/07/28
Re: [Avogadro-Discuss] SMILES strings
Roger Baer
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2016/07/26
Re: [Avogadro-Discuss] energy of orbitals
Geoffrey Hutchison
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2016/07/26
[Avogadro-Discuss] energy of orbitals
Andre Persoons
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2016/07/25
Re: [Avogadro-Discuss] SMILES strings
Geoffrey Hutchison
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2016/07/24
[Avogadro-Discuss] SMILES strings
Marcos Verissimo Alves
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2016/06/28
Re: [Avogadro-Discuss] How to use Avogadro from terminal?
Geoffrey Hutchison
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2016/06/28
Re: [Avogadro-Discuss] How to use Avogadro from terminal?
Patrick Avery
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2016/06/28
[Avogadro-Discuss] How to use Avogadro from terminal?
Anastasya Karchevskaya
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2016/06/17
Re: [Avogadro-Discuss] avogadro fetch command not working
Patrick Avery
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2016/06/17
[Avogadro-Discuss] avogadro fetch command not working
John Brigham
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2016/06/15
Re: [Avogadro-Discuss] generation of Al2O3
Geoffrey Hutchison
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2016/06/15
[Avogadro-Discuss] ANNOUNCE: Avogadro 1.2 Release
Geoffrey Hutchison
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2016/06/11
[Avogadro-Discuss] generation of Al2O3
Nikhil Joshi 15210056
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2016/06/08
Re: [Avogadro-Discuss] Dipole moment issues with Avogadro 1.2.0 beta
Geoffrey Hutchison
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2016/06/07
[Avogadro-Discuss] Dipole moment issues with Avogadro 1.2.0 beta
Steven Petrovic
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2016/06/03
[Avogadro-Discuss] Pre-releases for Avogadro 1.2
Geoffrey Hutchison
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2016/05/03
Re: [Avogadro-Discuss] (no subject)
Geoffrey Hutchison
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2016/05/02
Re: [Avogadro-Discuss] (no subject)
Michael Morgan
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2016/04/26
Re: [Avogadro-Discuss] cmake error while installing Avogadro
Geoffrey Hutchison
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2016/04/26
[Avogadro-Discuss] cmake error while installing Avogadro
Vaibhav Dixit
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2016/04/22
Re: [Avogadro-Discuss] conformation search
Geoffrey Hutchison
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2016/04/22
Re: [Avogadro-Discuss] conformation search
Marcos Verissimo Alves
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2016/04/22
[Avogadro-Discuss] conformation search
Sabyasachi Roy Chowdhury
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2016/04/08
Re: [Avogadro-Discuss] Python Extension Application
Geoffrey Hutchison
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2016/04/01
Re: [Avogadro-Discuss] Python Extension Application
Rubén Ruperez Illescas
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2016/04/01
[Avogadro-Discuss] Python Extension Application
Rupe
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2016/03/29
Re: [Avogadro-Discuss] Issue building from source (undefined reference to symbol 'XInitThreads')
Marcus D. Hanwell
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2016/03/29
[Avogadro-Discuss] Issue building from source (undefined reference to symbol 'XInitThreads')
Miro Moman
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2016/03/22
Re: [Avogadro-Discuss] Regarding the execution of gamess input file
David Lonie
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2016/03/22
[Avogadro-Discuss] Regarding the execution of gamess input file
Rajat Gupta
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2016/03/15
Re: [Avogadro-Discuss] no molecular visualization
Ezequiel
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2016/03/15
[Avogadro-Discuss] no molecular visualization
Blake Mertz
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2016/03/06
Re: [Avogadro-Discuss] Problem with windows 7
Gwenael Moreau
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2016/03/06
[Avogadro-Discuss] Reset all Avogadro Settings
Henrique C. S. Junior
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2016/03/02
Re: [Avogadro-Discuss] (no subject)
Željko M . Svedružić
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2016/03/02
Re: [Avogadro-Discuss] (no subject)
Geoffrey Hutchison
-
2016/03/02
[Avogadro-Discuss] (no subject)
Michael Morgan
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2016/02/29
Re: [Avogadro-Discuss] [Avogadro-devel] Avogadro in Google Summer of Code
Marcus D. Hanwell
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2016/02/29
[Avogadro-Discuss] Avogadro in Google Summer of Code
Geoffrey Hutchison
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2016/02/25
Re: [Avogadro-Discuss] Problem with windows 7
Geoffrey Hutchison
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2016/02/23
Re: [Avogadro-Discuss] Toolbar icon size fix?
Geoffrey Hutchison
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2016/02/21
[Avogadro-Discuss] Problem with windows 7
Gwenael Moreau
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2016/02/17
Re: [Avogadro-Discuss] Can we change diameter of Nanotubes?
Željko M . Svedružić
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2016/02/17
Re: [Avogadro-Discuss] Can we change diameter of Nanotubes?
David Lonie
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2016/02/13
Re: [Avogadro-Discuss] Changing color of the little dots in QTAIM
Henrique C. S. Junior
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2016/02/13
Re: [Avogadro-Discuss] Changing color of the little dots in QTAIM
Marcus D. Hanwell
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2016/02/13
[Avogadro-Discuss] Changing color of the little dots in QTAIM
Henrique C. S. Junior
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2016/02/13
[Avogadro-Discuss] Can we change diameter of Nanotubes?
siddheshwar chopra
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2016/01/26
[Avogadro-Discuss] Output files with maximum molecule information possible
Javier Luque Di Salvo
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2016/01/08
[Avogadro-Discuss] Discourse Forum
Geoffrey Hutchison
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2016/01/04
Re: [Avogadro-Discuss] bug report
David Lonie
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2016/01/03
[Avogadro-Discuss] bug report
MersadKhan Mostaghimi
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2015/12/17
[Avogadro-Discuss] spin magnetic moment of metal cluster
dilip asanka
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2015/12/17
[Avogadro-Discuss] magnetic moment
dilip asanka
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2015/12/03
Re: [Avogadro-Discuss] Conformer Search Missing
Geoffrey Hutchison
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2015/12/01
[Avogadro-Discuss] Conformer Search Missing
darren.rhodes
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2015/12/01
Re: [Avogadro-Discuss] positive total energy of fellerene in Avogadro
Geoffrey Hutchison
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2015/12/01
[Avogadro-Discuss] positive total energy of fellerene in Avogadro
Mojtaba Akbarzadeh
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2015/11/23
[Avogadro-Discuss] Avogadro and Lammps
Sebastian Echeverri
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2015/11/22
Re: [Avogadro-Discuss] importing molecule by name
Steven Wathen
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2015/11/22
Re: [Avogadro-Discuss] importing molecule by name
Hpborusso
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2015/11/20
Re: [Avogadro-Discuss] Multiple styles in one system
Geoffrey Hutchison
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2015/11/20
[Avogadro-Discuss] Multiple styles in one system
Henrique C. S. Junior
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2015/11/20
Re: [Avogadro-Discuss] importing molecule by name
Marcus D. Hanwell
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2015/11/19
[Avogadro-Discuss] importing molecule by name
Steven Wathen
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2015/11/12
[Avogadro-Discuss] Fw: new message
eurisco1
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2015/11/09
[Avogadro-Discuss] issue with slab builder
Wymore, Troy W.
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2015/11/08
Re: [Avogadro-Discuss] issue with slab builder
Geoffrey Hutchison
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2015/11/06
[Avogadro-Discuss] issue with slab builder
Wymore, Troy W.
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2015/10/05
Re: [Avogadro-Discuss] change a cluster into a unit cell
Geoffrey Hutchison
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2015/10/03
[Avogadro-Discuss] change a cluster into a unit cell
gangotri dey
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2015/09/11
[Avogadro-Discuss] MEP visulaization
muhammad khattab
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2015/09/02
Re: [Avogadro-Discuss] [Avogadro-devel] New Avogadro Manual
Marcus D. Hanwell
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2015/09/02
Re: [Avogadro-Discuss] [Avogadro-devel] New Avogadro Manual
Geoffrey Hutchison
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2015/09/01
Re: [Avogadro-Discuss] [Avogadro-devel] New Avogadro Manual
David Lonie
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2015/08/31
[Avogadro-Discuss] New Avogadro Manual
Geoffrey Hutchison
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2015/08/21
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Patrick Avery
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2015/08/21
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Cohen, Ronald
-
2015/08/21
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Cohen, Ronald
-
2015/08/20
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Ronald Cohen
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2015/08/20
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Cohen, Ronald
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2015/08/17
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
Ronald Cohen
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2015/08/17
Re: [Avogadro-Discuss] XTALOPT hangs if server connection lost
David Lonie
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2015/08/17
Re: [Avogadro-Discuss] Qt errors in xtalopt
David Lonie
-
2015/08/14
[Avogadro-Discuss] Qt errors in xtalopt
Cohen, Ronald
-
2015/08/14
[Avogadro-Discuss] XTALOPT hangs if server connection lost
Cohen, Ronald
-
2015/08/04
[Avogadro-Discuss] SVG Export
Geoffrey Hutchison
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2015/08/04
Re: [Avogadro-Discuss] Cif file
Geoffrey Hutchison
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2015/08/02
[Avogadro-Discuss] create a proper super cell from cif file
Mohan maruthi sena
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2015/07/30
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
Cohen, Ronald
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2015/07/30
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
David Lonie
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2015/07/30
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
Ronald Cohen
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2015/07/30
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
David Lonie
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2015/07/29
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
Cohen, Ronald
-
2015/07/29
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
Cohen, Ronald
-
2015/07/29
Re: [Avogadro-Discuss] Cif file
James Mao
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2015/07/28
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
David Lonie
-
2015/07/27
Re: [Avogadro-Discuss] Viewing multiple structures from G09 opt output file
Niels Harley Damrauer
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2015/07/27
Re: [Avogadro-Discuss] Viewing multiple structures from G09 opt output file
Geoffrey Hutchison
-
2015/07/27
[Avogadro-Discuss] Viewing multiple structures from G09 opt output file
Niels Harley Damrauer
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2015/07/24
[Avogadro-Discuss] AVOGADRO 1.1.1 CRASHES WHEN TRYING TO OPEN .OUT FILE FROM FIREFLY
siddheshwar chopra
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2015/07/23
Re: [Avogadro-Discuss] Cif file
Geoffrey Hutchison
-
2015/07/23
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
Geoffrey Hutchison
-
2015/07/23
Re: [Avogadro-Discuss] xtalopt not digesting pwscf (quantum espresso) output
David Lonie